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BDBM111152 US9695180, 4

SMILES: CN(C)[C@H]1CCN(Cc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3ccnc23)C1

InChI Key: InChIKey=ZQAXBGLALGKAEA-QWVACARCNA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 111152   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM111152
PNG
(US9695180, 4)
Show SMILES CN(C)[C@H]1CCN(Cc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3ccnc23)C1
Show InChI InChI=1/C27H28N6/c1-19-4-8-22(9-5-19)26-25(21-10-6-20(16-28)7-11-21)30-24(27-29-13-15-33(26)27)18-32-14-12-23(17-32)31(2)3/h4-11,13,15,23H,12,14,17-18H2,1-3H3/t23-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/a7.525



Incyte Corporation

US Patent


Assay Description
10 μL of 1 nM LSD-1 enzyme (ENZO BML-SE544-0050) in the assay buffer (50 mM Tris, pH 7.5, 0.01% Tween-20, 25 mM NaCl, 5 mM DTT) were preincubated ...


US Patent US9695180 (2017)


BindingDB Entry DOI: 10.7270/Q2WQ01ZW
More data for this
Ligand-Target Pair